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MCULE-5696446774
Compound
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- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 29 USD | 92 | 18 working days | Get Quote |
| 10 mg | 36 USD | 92 | 18 working days | Get Quote |
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1
MCULE-2359164432
- Component type: Main
-
1
MCULE-4467353796
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5696446774.sdf |
| SMILES | MCULE-5696446774.smiles |
| Standard InChI | MCULE-5696446774.inchi |
| InChIKey | MCULE-5696446774.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-854184144 | 95 | As is | 245 mg |
| P-674928334 | 90 | As is | 90 mg |
| P-13433451 | 92 | As is | 245 mg |
| P-893030009 | N/A | Main component | by synthesis |
| P-596417732 | 90 | Main component | 129 mg |
| P-653026299 | 90 | Main component | by synthesis |
| P-579250253 | 90 | Main component | in stock |
| P-33811691 | 90 | Main component | in stock |
| P-873080990 | 94 | Main component | by resynthesis (? - ? days) |
| P-852030599 | 90 | Main component | 55 mg |
| P-886410491 | N/A | Main component as a main component | by synthesis |
| P-4391538 | 90 | Main component as a main component | 25 mg |
| P-619315758 | 90 | Main component as a main component | 28 mg |
| P-675337906 | 90 | Main component as a main component | in stock |
| P-25738725 | 90 | Main component as a main component | 745 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 411.533 |
| logP | 4.2094 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 8 |
| PSA | 70.0 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 124.7561 |
| Atoms | 63 |
| Rings | 3 |
| Heavy atoms | 30 |
| Hydrogen atoms | 33 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
